BDBM15410 N-[4-hydroxy-3-(2-hydroxynaphthalen-1-yl)phenyl]thiophene-2-sulfonamide::naphthol compound 13
SMILES: Oc1ccc(NS(=O)(=O)c2cccs2)cc1-c1c(O)ccc2ccccc12
InChI Key: InChIKey=NYXDSXZBPWSAFA-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
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Heat shock protein HSP 90-beta (Homo sapiens (Human)) | BDBM15410 (N-[4-hydroxy-3-(2-hydroxynaphthalen-1-yl)phenyl]th...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase MMDB PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | 600 | n/a | n/a | n/a | n/a | 7.4 | 22 |
Vernalis (R&D) Ltd | Assay Description The assay is based upon displacement of a fluorescently labeled molecule, which binds specifically to the ATP-binding site of full-length human Hsp90... | Bioorg Med Chem Lett 15: 5187-91 (2005) Article DOI: 10.1016/j.bmcl.2005.08.092 BindingDB Entry DOI: 10.7270/Q2HH6H9Z | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |